1-(3,4-dimethylphenyl)-4-{[5-(2-hydroxy-5-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-4-{[5-(2-hydroxy-5-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
1-(3,4-dimethylphenyl)-4-{[5-(2-hydroxy-5-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 2237-1577 |
| Compound Name: | 1-(3,4-dimethylphenyl)-4-{[5-(2-hydroxy-5-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione |
| Molecular Weight: | 419.39 |
| Molecular Formula: | C22 H17 N3 O6 |
| Smiles: | Cc1ccc(cc1C)N1C(C(=C/c2ccc(c3cc(ccc3O)[N+]([O-])=O)o2)\C(N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8546 |
| logD: | 3.6161 |
| logSw: | -4.33 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.259 |
| InChI Key: | JKFICPIMSFBOJJ-UHFFFAOYSA-N |